Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSD | P07339 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | PPM1D | O15297 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 4/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | MITF | O75030 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.39 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL5300150 | 0.98 | PPM1D (0.44) | CTSDCA1CA2CA9PPM1D | |
| SCHEMBL9996739 | 0.83 | TP53 (0.47) | PPM1DALDH1A1NPC1KDM4EHPGD | |
| SCHEMBL4707109 | 0.82 | TP53 (0.49) | PPM1DNPC1RAB9AEPHX2KMT2A | |
| SCHEMBL7298560 | 0.80 | PPM1D (0.53) | PPM1DALDH1A1NPC1RAB9AEPHX2 | |
| SCHEMBL29818185 | 0.80 | TP53 (0.43) | PPM1DALDH1A1NPC1KDM4EHPGD | |
| SCHEMBL2303340 | 0.76 | KDM4E (0.44) | ALDH1A1NPC1KDM4EHPGDKMT2A | |
| SCHEMBL547637 | 0.74 | GRIK1 (0.58) | CA1CA2CA9PPM1DALDH1A1 | |
| SCHEMBL3647579 | 0.74 | GRIK1 (0.58) | CA1CA2CA9PPM1DALDH1A1 | |
| SCHEMBL15389212 | 0.74 | TSHR (0.51) | ALDH1A1KDM4EHPGDHTTGAA | |
| SCHEMBL3953587 | 0.73 | HDAC3 (0.50) | CTSDCA1CA2CA9ALDH1A1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2007025774-A2 | CYSTEINE PROTEASE INHIBITORS | GLAXO GROUP LIMITED (GB) | 2007-03-08 | — | — | WO | disclosed |
| WO-2007025776-A2 | CYSTEINE PROTEASE INHIBITORS | GLAXO GROUP LIMITED (GB) | 2007-03-08 | — | — | WO | disclosed |